N-[4-(4-azanylpiperidin-1-yl)-2-phenyl-butyl]-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-(4-azanylpiperidin-1-yl)-2-phenyl-butyl]-N-methyl-benzenesulfonamide Openeye Name: N-[4-(4-amino-1-piperidyl)-2-phenyl-butyl]-N-methyl-benzenesulfonamide CAS Name: N-[4-(4-amino-1-piperidinyl)-2-phenylbutyl]-N-methylbenzenesulfonamide IUPAC Name: N-[4-(4-aminopiperidin-1-yl)-2-phenylbutyl]-N-methylbenzenesulfonamide Traditional Name: N-[4-(4-aminopiperidino)-2-phenyl-butyl]-N-methyl-benzenesulfonamide Formula: C22H31N3O2S MolecularWeight: 401.56544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCN1CCC(CC1)N)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC(CCN1CCC(CC1)N)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O2S/c1-24(28(26,27)22-10-6-3-7-11-22)18-20(19-8-4-2-5-9-19)12-15-25-16-13-21(23)14-17-25/h2-11,20-21H,12-18,23H2,1H3